[gmx-users] dipole on an atom

David van der Spoel spoel at xray.bmc.uu.se
Sun Nov 5 15:43:00 CET 2017

On 04/11/17 19:19, Faezeh Pousaneh wrote:
> Hi,
> I have an uncharged atom, and I would like to give it a dipole. Any
> suggestion?
impossible in gromacs.
> Best regards

David van der Spoel, Ph.D., Professor of Biology
Head of Department, Cell & Molecular Biology, Uppsala University.
Box 596, SE-75124 Uppsala, Sweden. Phone: +46184714205.

More information about the gromacs.org_gmx-users mailing list